Chemical Property of Nemorubicin
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Chemical Property:
- Vapor Pressure:6.68E-31mmHg at 25°C
- Boiling Point:852.2°Cat760mmHg
- PKA:7.35±0.60(Predicted)
- Flash Point:469.2°C
- PSA：201.75000
- Density:1.55g/cm3
- LogP:0.28520
- XLogP3:1.7
- Hydrogen Bond Donor Count:5
- Hydrogen Bond Acceptor Count:14
- Rotatable Bond Count:7
- Exact Mass:643.22649023
- Heavy Atom Count:46
- Complexity:1160
- Purity/Quality:
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98%,99%, *data from raw suppliers
Nemorubicin *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
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SDS file from LookChem
Useful:
- Canonical SMILES:CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N6CCOC(C6)OC)O
- Isomeric SMILES:C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N6CCO[C@@H](C6)OC)O
- Recent EU Clinical Trials:Phase II randomized study of nemorubicin hydrochloride (PNU-152243A) or doxorubicin administered in adult patients with unresectable hepatocellular carcinoma
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Uses
Nemorubicin is a doxorubicin derivative that differs significantly from its parent drug in terms of spectrum of antitumor activity, metabolism and toxicity profile. The drug is active on tumors resistant to alkylating agents, topoisomerase II inhibitors and platinum derivatives. It works primarily through topoisomerase I inhibition. Of note, Nemorubicin is active in cells with upregulation of the nucleotide excision repair (NER) pathway, where current therapies fail. Nemorubicin is biotransformed in the liver into cytotoxic metabolites that may further contribute to render this drug highly active against primary liver tumors or liver metastases.
